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6-Chloroquinoline-8-carboxylic acid

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Name

6-Chloroquinoline-8-carboxylic acid

EINECS N/A
CAS No. 6456-78-6 Density 1.469 g/cm3
PSA 50.19000 LogP 2.58640
Solubility N/A Melting Point 220-222°C
Formula C10H6ClNO2 Boiling Point 410.3 °C at 760 mmHg
Molecular Weight 207.616 Flash Point 202 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 6456-78-6 (6-chloroquinoline-8-carboxylic acid) Hazard Symbols N/A
Synonyms

6-Chloro-8-quinolinecarboxylicacid;6-Chloroquinoline-8-carboxylic acid;6-Chloro-8-quinolinecarboxylic;

Article Data 6

6-Chloroquinoline-8-carboxylic acid Specification

The 8-Quinolinecarboxylicacid, 6-chloro-, with the CAS registry number 6456-78-6, is also known as 6-Chloro-8-quinolinecarboxylic acid. This chemical's molecular formula is C10H6ClNO2 and molecular weight is 207.61. What's more, its systematic name is 6-Chloroquinoline-8-carboxylic acid.

Physical properties of 8-Quinolinecarboxylicacid, 6-chloro- are: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1.21; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 39.19 Å2; (11)Index of Refraction: 1.69; (12)Molar Refractivity: 54.01 cm3; (13)Molar Volume: 141.2 cm3; (14)Polarizability: 21.41×10-24 cm3; (15)Surface Tension: 66.4 dyne/cm; (16)Density: 1.469 g/cm3; (17)Flash Point: 202 °C; (18)Enthalpy of Vaporization: 69.87 kJ/mol; (19)Boiling Point: 410.3 °C at 760 mmHg; (20)Vapour Pressure: 1.81E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(Cl)cc2cccnc12
(2)InChI: InChI=1S/C10H6ClNO2/c11-7-4-6-2-1-3-12-9(6)8(5-7)10(13)14/h1-5H,(H,13,14)
(3)InChIKey: GGHKFVNCVUIGRP-UHFFFAOYSA-N

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